Basic Information | Post buying leads | Suppliers | Cas Database |
Name |
2-(Chloromethyl)phenylacetic acid |
EINECS | N/A |
CAS No. | 95335-46-9 | Density | 1.277 g/cm3 |
PSA | 37.30000 | LogP | 2.05250 |
Solubility | N/A | Melting Point |
N/A |
Formula | C9H9ClO2 | Boiling Point | 323.754 °C at 760 mmHg |
Molecular Weight | 184.622 | Flash Point | 149.601 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
2-Chloromethylbenzeneaceticacid;2-[2-(Chlorognbvnbvnmethyl)phenyl]acetic acid;2-[2-(Chloromethyl)phenyl]acetic acid; |
Article Data | 4 |
The 2-(Chloromethyl)phenylacetic acid is an organic compound with the formula C9H9ClO2. The systematic name of this chemical is [2-(chloromethyl)phenyl]acetic acid. With the CAS registry number 95335-46-9, it is also named as 2-(Chloromethyl)phenylaceticacid.
Physical properties about 2-(Chloromethyl)phenylacetic acid are: (1)ACD/LogP: 1.75; (2)ACD/LogD (pH 5.5): 1; (3)ACD/LogD (pH 7.4): -1; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 12; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 2; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 3; (11)Polar Surface Area: 37.3 Å2; (12)Index of Refraction: 1.566; (13)Molar Refractivity: 47.132 cm3; (14)Molar Volume: 144.572 cm3; (15)Polarizability: 18.685×10-24cm3; (16)Surface Tension: 48.194 dyne/cm; (17)Density: 1.277 g/cm3; (18)Flash Point: 149.601 °C; (19)Enthalpy of Vaporization: 59.721 kJ/mol; (20)Boiling Point: 323.754 °C at 760 mmHg.
You can still convert the following datas into molecular structure:
(1)SMILES: ClCc1ccccc1CC(=O)O
(2)InChI: InChI=1/C9H9ClO2/c10-6-8-4-2-1-3-7(8)5-9(11)12/h1-4H,5-6H2,(H,11,12)
(3)InChIKey: RFYCQJHCAPCSTA-UHFFFAOYAP
(4)Std. InChI: InChI=1S/C9H9ClO2/c10-6-8-4-2-1-3-7(8)5-9(11)12/h1-4H,5-6H2,(H,11,12)
(5)Std. InChIKey: RFYCQJHCAPCSTA-UHFFFAOYSA-N